(3S)-3-[ethanoyl-(4-iodophenyl)amino]-6-oxidanyl-hexanoic acid

Systemtic Name: (3S)-3-[ethanoyl-(4-iodophenyl)amino]-6-oxidanyl-hexanoic acid Openeye Name: (3S)-3-(N-acetyl-4-iodo-anilino)-6-hydroxy-hexanoic acid CAS Name: (3S)-3-(N-acetyl-4-iodoanilino)-6-hydroxyhexanoic acid IUPAC Name: (3S)-3-(N-acetyl-4-iodoanilino)-6-hydroxyhexanoic acid Traditional Name: (3S)-3-(N-acetyl-4-iodo-anilino)-6-hydroxy-hexanoic acid Formula: C14H18INO4 MolecularWeight: 391.20149

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=C(C=C1)I)C(CCCO)CC(=O)O

Isomeric SMILES

CC(=O)N(C1=CC=C(C=C1)I)[C@@H](CCCO)CC(=O)O

InChI

InChI=1S/C14H18INO4/c1-10(18)16(12-6-4-11(15)5-7-12)13(3-2-8-17)9-14(19)20/h4-7,13,17H,2-3,8-9H2,1H3,(H,19,20)/t13-/m0/s1